N-Boc-4-isothiocyanatoaniline

Base Information

Chemical Name:N-Boc-4-isothiocyanatoaniline
CAS No.:89631-75-4
Molecular Formula:C12H14 N2 O2 S
Molecular Weight:250.321
Hs Code.:
European Community (EC) Number:621-328-6
DSSTox Substance ID:DTXSID20350918
Mol file:89631-75-4.mol

Synonyms:N-Boc-4-isothiocyanatoaniline;89631-75-4;tert-Butyl N-(4-isothiocyanatophenyl)carbamate;SCHEMBL2546241;DTXSID20350918;KMOFDGFIFPIQCT-UHFFFAOYSA-N;AKOS015894708;tert-butyl-4-isothiocyanatophenylcarbamate;N-Boc-4-isothiocyanatoaniline, >=98.0% (HPLC)

Suppliers and Price of N-Boc-4-isothiocyanatoaniline

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
N-Boc-4-isothiocyanatoaniline ≥98.0% (HPLC)
500mg
$ 176.00

American Custom Chemicals Corporation
N-BOC-4-ISOTHIOCYANATOANILINE 95.00%
500MG
$ 749.48

AK Scientific
N-Boc-4-isothiocyanatoaniline
500mg
$ 316.00

Absolute Chiral
N-Boc-4-isothiocyanatoaniline 95%
250 mg
$ 78.00

Total 6 raw suppliers

Chemical Property of N-Boc-4-isothiocyanatoaniline

Chemical Property:

Vapor Pressure:0.000181mmHg at 25°C
Melting Point:109-114 °C
Refractive Index:1.552
Boiling Point:329.2°C at 760 mmHg
Flash Point:152.9°C
Density:1.12g/cm³
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:250.07759887
Heavy Atom Count:17
Complexity:311

Purity/Quality:

98%Min ^*data from raw suppliers

N-Boc-4-isothiocyanatoaniline ≥98.0% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 42
Safety Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)NC1=CC=C(C=C1)N=C=S

Technology Process of N-Boc-4-isothiocyanatoaniline

There total 1 articles about N-Boc-4-isothiocyanatoaniline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 83.0%